Compound Detail
CHEMBL4524199
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Basic Information
| ChEMBL ID | CHEMBL4524199 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JCZSBVZAGIPHRO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
390.8
MW (Da)
4.02
ALogP
3
HBA
1
HBD
66.5
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bromodomain-containing protein 4 CHEMBL1163125 | IC50 | 7.04 | 6.23 | 91.3 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bromodomain-containing protein 4 | IC50 | = | 91.3 | nM | 7.04 | Displacement of tetra-acetylated histone H4 peptide (1-21) from recombinant huma... | 31789032 |
| Bromodomain-containing protein 4 | IC50 | = | 3828.0 | nM | 5.42 | Displacement of tetra-acetylated histone H4 peptide (1-21) from recombinant huma... | 31789032 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31789032 | 10.1021/acs.jmedchem.9b01010 | Bromodomain-containing protein 4 | 3 |
| 31789032 | 10.1021/acs.jmedchem.9b01010 | Unchecked | 1 |
| 31789032 | 10.1021/acs.jmedchem.9b01010 | RAW264.7 | 1 |
Data from ChEMBL 36 via Core Engine